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Gibberellic acid-acetoxymethyl ester

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For Research Use Only | Not For Clinical Use
CATAPS1373154687
CAS1373154-68-7
Synonyms4a,1-(Epoxymethano)-7,9a-methanobenz[a]azulene-10-acetic acid, 1,2,4b,5,6,7,8,9,10,10a-decahydro-2,7-dihydroxy-1-methyl-8-methylene-13-oxo-, (acetyloxy)methyl ester, (1S,2S,4aR,4bR,7S,9aS,10S,10aR)-,Gibberellic Acid Acetoxymethyl Ester
Molecular Weight418.44
Molecular FormulaC22H26O8
Canonical SMILESCC(=O)OCOC(=O)[C@H]1[C@@H]2[C@@]3(C)[C@@H](O)C=C[C@@]2(OC3=O)[C@@H]4CC[C@]5(O)C[C@]14CC5=C
InChIInChI=1S/C22H26O8/c1-11-8-20-9-21(11,27)6-4-13(20)22-7-5-14(24)19(3,18(26)30-22)16(22)15(20)17(25)29-10-28-12(2)23/h5,7,13-16,24,27H,1,4,6,8-10H2,2-3H3/t13-,14+,15-,16-,19-,20+,21+,22-/m1/s1
Accurate Mass418.1628
FormatNeat
SubcategoryAdditional pesticides and metabolites
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